4-methoxy-3-(methylaminomethyl)phenol

C9H13NO2 — CID 84731678

IUPAC4-methoxy-3-(methylaminomethyl)phenol
SMILESCNCc1cc(O)ccc1OC
InChIInChI=1S/C9H13NO2/c1-10-6-7-5-8(11)3-4-9(7)12-2/h3-5,10-11H,6H2,1-2H3
InChIKeySWQNPBASJPBYLH-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.12
Rot. Bonds3

About 4-methoxy-3-(methylaminomethyl)phenol

4-methoxy-3-(methylaminomethyl)phenol (PubChem CID 84731678) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is 4-methoxy-3-(methylaminomethyl)phenol.

Molecular Properties

Compound Name4-methoxy-3-(methylaminomethyl)phenol
PubChem CID84731678
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name4-methoxy-3-(methylaminomethyl)phenol
SMILESCNCc1cc(O)ccc1OC
InChIInChI=1S/C9H13NO2/c1-10-6-7-5-8(11)3-4-9(7)12-2/h3-5,10-11H,6H2,1-2H3
InChIKeySWQNPBASJPBYLH-UHFFFAOYSA-N
XLogP1.12
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-3-[3-(methylamino)propyl]phenol
CID 84733265
4-methoxy-3-(methylaminomethyl)aniline
CID 21415904
1-[5-chloro-2-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine
CID 43646631
4-methoxy-3-(3-methylbut-2-enyl)phenol
CID 101027686
1-(2-methoxy-5-phenoxyphenyl)-N-methylmethanamine
CID 82552149
1-[2-methoxy-5-[(E)-2-phenylethenyl]phenyl]-N-methylmethanamine
CID 56707768
N'-[(5-bromo-2-methoxyphenyl)methyl]-N-methylmethanediamine
CID 115226819
3-[(1-hydroxycyclopropyl)methyl]-4-methoxyphenol
CID 117284575
4-methoxy-3-[(5-methoxy-2-pyridinyl)methyl]phenol
CID 14333130
4-methoxy-3-[2-methyl-1-(methylamino)propan-2-yl]phenol
CID 105425938
2-methoxy-5-methyl-4-(methylaminomethyl)phenol
CID 105422769
1-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine
CID 106484539

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-(methylaminomethyl)phenol?
The IUPAC name of 4-methoxy-3-(methylaminomethyl)phenol (CID 84731678) is 4-methoxy-3-(methylaminomethyl)phenol.
What is the SMILES notation for 4-methoxy-3-(methylaminomethyl)phenol?
The canonical SMILES for 4-methoxy-3-(methylaminomethyl)phenol is CNCc1cc(O)ccc1OC.
What is the InChIKey of 4-methoxy-3-(methylaminomethyl)phenol?
The InChIKey is SWQNPBASJPBYLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c1-10-6-7-5-8(11)3-4-9(7)12-2/h3-5,10-11H,6H2,1-2H3.
What are the key properties of 4-methoxy-3-(methylaminomethyl)phenol?
4-methoxy-3-(methylaminomethyl)phenol has a molecular weight of 167.21 g/mol, XLogP of 1.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-(methylaminomethyl)phenol is sourced from PubChem (CID 84731678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).